Название: ethyl 3-(5-chloro-1,3-dioxo-1,3-dihydro-isoindol-2-yl)-2-(2-methyl-[1,3]dioxolan-2-yl)propionate
SMILES:
CCOC(=O)C(CN1C(=O)c2ccc(Cl)cc2C1=O)C1(C)OCCO1Molecular Processing
Molecular formula
C17H18ClNO6
Molecular weight
367.79
Exact mass
367.0823
XLogP
1.88
TPSA
82.14
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.471
Molar refractivity
87.25
Supplementary Information
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